# generated using pymatgen
data_Cu2GeSe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98587371
_cell_length_b   5.53631094
_cell_length_c   6.78254633
_cell_angle_alpha   114.08736712
_cell_angle_beta   107.08757275
_cell_angle_gamma   89.99999949
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2GeSe3
_chemical_formula_sum   'Cu2 Ge1 Se3'
_cell_volume   129.36715667
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Cu  Cu0  1  0.83309587  0.57150426  0.66619074  1.0
  Cu  Cu1  1  0.16690413  0.90531353  0.33380926  1.0
  Ge  Ge2  1  0.50000000  0.26676799  -0.00000000  1.0
  Se  Se3  1  0.66999489  0.67071366  0.33999177  1.0
  Se  Se4  1  0.33000511  0.33072389  0.66000823  1.0
  Se  Se5  1  0.00000000  0.99297466  -0.00000000  1.0